3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one
TL;DR: 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one (CAS 876879-07-1) is a chemical compound with molecular formula C12H10N2O4S and molecular weight 278.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one
Also Known As: BAS 10851287, 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one, 3-[[2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]oxolan-2-one, 3-((5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl)thio)dihydrofuran-2(3H)-one, 3-[[2-(4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3,4-oxadiazol-5-yl]thio]-2-oxolanone
| Molecular Formula | C12H10N2O4S |
|---|---|
| Molecular Weight | 278.04 g/mol |
| LogP | 1.8498 |
| Topological Polar Surface Area | 85.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.03613 |
| Heavy Atoms | 19 |
| Complexity | 596.0318 |
Chemical Identifiers
| CAS Number | 876879-07-1 |
|---|---|
| SMILES | C1COC(=O)C1SC2=NN=C(O2)C3=CC=C(C=C3)O |
Product Overview
3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one (CAS 876879-07-1), with molecular formula C12H10N2O4S and molecular weight 278.04 g/mol. IUPAC: 3-[[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one.
Chemical Property Profile of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one
Property Insights of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one
The XLogP value of 1.8498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one. The TPSA of 85.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one. Following Lipinski's Rule of Five, 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one?
The CAS number of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one is 876879-07-1.
What is the molecular formula of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one?
The molecular formula of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one is C12H10N2O4S.
What is the molecular weight of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one?
The molecular weight of 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one is 278.04 g/mol.
Where can I buy 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one?
You can request a quote for 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-(4-Hydroxy-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-dihydro-furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.